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1XRQ

Crystal structure of active site F1-mutant E245Q soaked with peptide Phe-Leu

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU RU300
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2003-05-27
DetectorMARRESEARCH
Wavelength(s)1.5418
Spacegroup nameP 21 21 21
Unit cell lengths57.560, 61.910, 80.030
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution19.980 - 2.800
R-factor0.204
Rwork0.204
R-free0.29300
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.008
RMSD bond angle1.100
Data reduction softwareMOSFLM
Data scaling softwareCCP4 ((TRUNCATE))
Phasing softwareCNS
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]20.0002.970
High resolution limit [Å]2.7802.780
Number of reflections6902
<I/σ(I)>13.1
Completeness [%]99.259.4
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6293PEG 6000, Bis-Tris, pH 6.0, VAPOR DIFFUSION, HANGING DROP, temperature 293.0K

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